SCHEMBL30596256

SCHEMBL30596256

CCOc1nc(C#N)cc2c1cnn2C1CCOCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 1.00
PDE1B Q01064 12/20 0.42
PDE1C Q14123 12/20 0.42
PDE1A P54750 11/20 0.42
LRRK2 Q5S007 2/20 0.42
PDE9A O76083 3/20 0.40
PIK3CD O00329 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30596250 0.82 PDE4D (1.00) PDE4DPDE1BPDE1CPDE1ALRRK2
SCHEMBL30596248 0.79 PDE4D (0.69) PDE4DPDE1BPDE1CPDE1A
SCHEMBL30596269 0.78 PDE4D (0.67) PDE4DPDE1BPDE1CPDE1APDE9A
SCHEMBL30596273 0.75 PDE4D (0.85) PDE4DPDE1BPDE1CPDE1ALRRK2
SCHEMBL30596262 0.75 PDE4D (0.62) PDE4DPDE1BPDE1CPDE1A
SCHEMBL30596258 0.68 PDE4D (0.73) PDE4DPDE1BPDE1CPDE1APDE9A
SCHEMBL16985497 0.65 LRRK2 (0.56) PDE4DLRRK2
SCHEMBL17485775 0.64 PDE4D (0.49) PDE4DPDE1BPDE1CPDE1A
SCHEMBL26181460 0.64 PDE4D (0.46) PDE4D
SCHEMBL16985495 0.63 LRRK2 (0.54) PDE4DLRRK2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116836162-A Pyrazolo [4,3-c ] pyridine compound or pharmaceutically acceptable salt thereof and application thereof 南方医科大学 2023-10-03 CN disclosed